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2-(3,5,5-trimethylhexyl)benzoate

2-(3,5,5-trimethylhexyl)benzoate

Systemtic Name:2-(3,5,5-trimethylhexyl)benzoate
Openeye Name:2-(3,5,5-trimethylhexyl)benzoate
CAS Name:2-(3,5,5-trimethylhexyl)benzoate
IUPAC Name:2-(3,5,5-trimethylhexyl)benzoate
Traditional Name:2-(3,5,5-trimethylhexyl)benzoate
Formula: C16H23O2-
MolecularWeight: 247.35262
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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1C(=O)[O-])CC(C)(C)C


Isomeric SMILES

CC(CCC1=CC=CC=C1C(=O)[O-])CC(C)(C)C


InChI

InChI=1S/C16H24O2/c1-12(11-16(2,3)4)9-10-13-7-5-6-8-14(13)15(17)18/h5-8,12H,9-11H2,1-4H3,(H,17,18)/p-1


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